Chemical Properties of 1,4:5,8-dimethano-naphthalene,1,2,4,4a,8,8,8a-octahydro- (CAS 21635-90-5)

1,4:5,8-dimethano-naphthalene,1,2,4,4a,8,8,8a-octahydro-

InChI
InChI=1S/C12H16/c1-2-8-5-7(1)11-9-3-4-10(6-9)12(8)11/h1-2,7-12H,3-6H2
InChI Key
XBFJAVXCNXDMBH-UHFFFAOYSA-N
Formula
C12H16
SMILES
C1=CC2CC1C1C3CCC(C3)C21
Molecular Weight1
160.26
CAS
21635-90-5
Other Names
  • Tetracyclo[6.2.1.1(3,6).0(2,7)]dodec-9-ene
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Physical Properties

Property Value Unit Source
ΔfH°gas 102.16 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 22.74 kJ/mol Joback Calculated Property
ΔvapH° 56.07 kJ/mol Relay (1.0) Calculated Property
IE [8.60; 8.85] eV Show Hide
IE 8.60 eV NIST
IE 8.85 ± 0.03 eV NIST
logPoct/wat 2.855 Crippen Calculated Property
McVol 132.200 ml/mol McGowan Calculated Property
Tboil 491.55 K Relay (1.0) Calculated Property

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [164.33; 539.39] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A-1.89330e+02
Coefficient B1.63840e+00
Coefficient C-1.38628e-03
Coefficient D4.76600e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 164.33 J/mol×K 273.00 Calculated Property
Cp,gas 237.90 J/mol×K 353.78 Calculated Property
Cp,gas 299.97 J/mol×K 434.56 Calculated Property
Cp,gas 352.07 J/mol×K 515.33 Calculated Property
Cp,gas 395.68 J/mol×K 596.11 Calculated Property
Cp,gas 432.33 J/mol×K 676.89 Calculated Property
Cp,gas 463.52 J/mol×K 757.67 Calculated Property
Cp,gas 490.75 J/mol×K 838.44 Calculated Property
Cp,gas 515.54 J/mol×K 919.22 Calculated Property
Cp,gas 539.39 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0006017; 0.0034791] Pa×s [289.04; 496.42] Joback Predicted correlation Show Hide
EquationY = exp(A + B/T + C·ln(T) + D·T^E)
Y is η in Pa×s, T in K
Coefficient A-3.21520e+00
Coefficient B-1.21414e+03
Coefficient C0.00000e+00
Coefficient D0.00000e+00
Coefficient E0.00000e+00
Temperature range, min.289.04
Temperature range, max.496.42
η 0.0006017 Pa×s 289.04 Calculated Property
η 0.0008205 Pa×s 312.08 Calculated Property
η 0.0010721 Pa×s 335.13 Calculated Property
η 0.0013535 Pa×s 358.17 Calculated Property
η 0.0016613 Pa×s 381.21 Calculated Property
η 0.0019920 Pa×s 404.25 Calculated Property
η 0.0023422 Pa×s 427.30 Calculated Property
η 0.0027088 Pa×s 450.34 Calculated Property
η 0.0030886 Pa×s 473.38 Calculated Property
η 0.0034791 Pa×s 496.42 Calculated Property

Similar Compounds

1,4:5,8-Dimethanonaphthalene, 1,2,3,4,4a,5,8,8a-octahydro-, (1«alpha»,4«alpha»,5«beta»,8«beta»)-. 1,4:5,8-Dimethanonaphthalene, (1 alpha,4 alpha,4a beta,5 alpha,8 alpha,8a beta) 1,2,3,4,4a,5,8,8a-octahydro-. 1,4:5,8:9,10-Trimethanoanthracene, 1,2,3,4,4a,5,8,8a,9,9a,10,10a-dodecahydro-(1«alpha»,4«alpha»,4a«alpha»,5«beta»,8«beta»8a«alpha»,9.beta,9a«alpha»,10«beta»,10a«alpha»)-. 1,4:5,8:9,10-Trimethanoanthracene, 1,2,3,4,4a,5,8,8a,9,9a,10,10a-dodecahydro-(1«alpha»,4«alpha»,4a«beta»,5«beta»,8«beta»,8a«beta»,9«alpha»,9a«beta»,10«alpha»,10a«beta»)-. 1,4:5,8:9,10-Trimethanoanthracene, 1,2,3,4,4a,5,8,8a,9,9a,10,10a-dodecahydro-(1«alpha»,4«alpha»,4a«alpha»,5«alpha»,8«alpha»,8a«alpha»,9«beta»,9a«alpha»,10«beta»,10a«alpha»)-. 1,4:5,8-Dimethanonaphthalene, 1,2,3,4,4a,5,8,8a-octahydro-, (1«alpha»,4«alpha»,4a«alpha»,5«beta»,8«beta»,8a«alpha»)-. Dicyclopentadiene, 1,2-dihydro, endo. Dicyclopentadiene, 1,2-dihydro, exo. Tetrahydrotriquinacene. 1,4:5,8:9,10-Trimethanoanthracene, 1,4,4a,5,8,8a,9,9a,10,10a-decahydro-(1«alpha»,4«alpha»,4a«alpha»,5«beta»,8«beta»,8a«alpha»,9«beta»,9a«alpha»,10«beta»,10a«alpha»)-. 1,4:5,8:9,10-Trimethanoanthracene, 1,4,4a,5,8,8a,9,9a,10,10a-decahydro-(1«alpha»,4«alpha»,4a«alpha»,5«alpha»,8«alpha»,8a«alpha»,9«beta»,9a«alpha»,10«beta»,10a«alpha»)-. 1,4:5,8:9,10-Trimethanoanthracene, 1,4,4a,5,8,8a,9,9a,10,10a-decahydro-(1«alpha»,4«alpha»,4a«alpha»,5«alpha»,8«alpha»,8a«alpha»,9«alpha»,9a«beta»,10«alpha»,10a«beta»)-. 1,4:5,8-Dimethanonaphthalene,1,4,4a,5,8,8a-hexahydro-,(1«alpha»,4«alpha»,4a«alpha»,5«alpha»,8«alpha»,8a«alpha»)-. 1,4,5,8-Dimethanonaphthalene, 1,4,4a,5,8,8a-hexahydro-, (1«alpha»,4«alpha»,4a«beta»,5«alpha»,8«alpha»,8a«beta»)-. 1,4:5,8-Dimethanonaphthalene,1,4,4a,5,8,8a-hexahydro-,(1«alpha»,4«alpha»,4a«alpha»,5«beta»,8«beta»,8a«alpha»)-.

Find more compounds similar to 1,4:5,8-dimethano-naphthalene,1,2,4,4a,8,8,8a-octahydro-.

Sources

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